COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.584  -2.071  -0.289  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.086  -0.137  -0.104  1.00  0.00           C  
HETATM    3  C   UNL     1       1.621  -0.684  -0.237  1.00  0.00           C  
HETATM    4  C   UNL     1       2.814  -0.034   0.014  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.767  -2.120  -0.344  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.855  -0.734  -0.297  1.00  0.00           C  
HETATM    7  C   UNL     1       0.370   0.114  -0.451  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.047  -2.341  -0.020  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.213  -0.958   0.038  1.00  0.00           C  
HETATM   10  C   UNL     1       2.751  -2.803  -0.092  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.041  -0.355   0.750  1.00  0.00           C  
HETATM   12  O   UNL     1      -8.863   0.505  -0.049  1.00  0.00           O  
HETATM   13  C   UNL     1      -7.671   0.990  -0.679  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.908   0.669   0.612  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.929   1.786   1.658  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.574   0.082   0.405  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.510  -0.387   0.240  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.856  -2.867  -0.205  1.00  0.00           N  
HETATM   19  O   UNL     1       0.426  -2.729  -0.535  1.00  0.00           O  
HETATM   20  C   UNL     1       0.391   0.777  -1.844  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.194   2.064  -1.551  1.00  0.00           O  
HETATM   22  C   UNL     1       0.009   2.320  -0.243  1.00  0.00           C  
HETATM   23  N   UNL     1       0.326   1.270   0.454  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.108   3.575   0.302  1.00  0.00           N  
HETATM   25  C   UNL     1       3.943  -2.159   0.158  1.00  0.00           C  
HETATM   26  C   UNL     1       3.981  -0.766   0.215  1.00  0.00           C  
HETATM   27  C   UNL     1       5.261  -0.067   0.483  1.00  0.00           C  
HETATM   28  C   UNL     1       6.063  -0.443   1.564  1.00  0.00           C  
HETATM   29  C   UNL     1       7.249   0.241   1.772  1.00  0.00           C  
HETATM   30  C   UNL     1       7.600   1.265   0.912  1.00  0.00           C  
HETATM   31  N   UNL     1       6.824   1.599  -0.101  1.00  0.00           N  
HETATM   32  C   UNL     1       5.688   0.974  -0.344  1.00  0.00           C  
HETATM   33  F   UNL     1       4.926   1.351  -1.394  1.00  0.00           F  
HETATM   34  H   UNL     1      -2.179   0.938  -0.064  1.00  0.00           H  
HETATM   35  H   UNL     1       2.841   1.044   0.054  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.906  -2.987   0.089  1.00  0.00           H  
HETATM   37  H   UNL     1       2.723  -3.882  -0.136  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.399  -0.469   1.773  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.822  -1.311   0.273  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.355   0.386  -1.530  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.705   2.055  -0.909  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.843   1.352   2.654  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.092   2.463   1.483  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.865   2.338   1.581  1.00  0.00           H  
HETATM   45  H   UNL     1       1.412   0.884  -2.211  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.221   0.219  -2.553  1.00  0.00           H  
HETATM   47  H   UNL     1       0.048   3.709   1.250  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.347   4.328  -0.261  1.00  0.00           H  
HETATM   49  H   UNL     1       4.846  -2.731   0.311  1.00  0.00           H  
HETATM   50  H   UNL     1       5.765  -1.246   2.221  1.00  0.00           H  
HETATM   51  H   UNL     1       7.892  -0.022   2.598  1.00  0.00           H  
HETATM   52  H   UNL     1       8.524   1.800   1.073  1.00  0.00           H  
CONECT    1    3    3   10   19                                       
CONECT    2    6    6    9   34                                       
CONECT    3    4    7    1    1                                       
CONECT    4   26   26    3   35                                       
CONECT    5    6   19   18   18                                       
CONECT    6    7    2    2    5                                       
CONECT    7   23    3   20    6                                       
CONECT    8    9    9   18   36                                       
CONECT    9    2    8    8   17                                       
CONECT   10   25   25    1   37                                       
CONECT   11   14   12   38   39                                       
CONECT   12   11   13                                                 
CONECT   13   14   12   40   41                                       
CONECT   14   15   16   11   13                                       
CONECT   15   14   42   43   44                                       
CONECT   16   17   17   17   14                                       
CONECT   17    9   16   16   16                                       
CONECT   18    5    5    8                                            
CONECT   19    1    5                                                 
CONECT   20   21    7   45   46                                       
CONECT   21   22   20                                                 
CONECT   22   24   23   23   21                                       
CONECT   23   22   22    7                                            
CONECT   24   22   47   48                                            
CONECT   25   26   10   10   49                                       
CONECT   26   27    4    4   25                                       
CONECT   27   32   32   28   26                                       
CONECT   28   29   29   27   50                                       
CONECT   29   30   28   28   51                                       
CONECT   30   31   31   29   52                                       
CONECT   31   30   30   32                                            
CONECT   32   31   33   27   27                                       
CONECT   33   32                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
